SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ipo'

List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EQU_A_EQIA329_0
(PROTEIN (ESTRADIOL
17
BETA-DEHYDROGENASE
1))		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		5 / 10 VAL A 170
LEU A 151
TYR A 229
GLY A 188
PRO A 187
 None
 1.40A 1equA-3ipoA:
undetectable		 1equA-3ipoA:
22.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1K74_A_9CRA463_2
(RETINOIC ACID
RECEPTOR RXR-ALPHA)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		3 / 3 GLN A 289
ILE A 192
HIS A 218
 None
 0.72A 1k74A-3ipoA:
undetectable		 1k74A-3ipoA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1KW0_A_H4BA429_1
(PHENYLALANINE-4-HYDR
OXYLASE)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		5 / 12 LEU A 254
LEU A 145
HIS A 354
TYR A 397
GLU A 393
 None
 0.85A 1kw0A-3ipoA:
undetectable		 1kw0A-3ipoA:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MMK_A_H4BA1427_1
(PHENYLALANINE-4-HYDR
OXYLASE)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		5 / 12 LEU A 254
LEU A 145
HIS A 354
TYR A 397
GLU A 393
 None
 0.83A 1mmkA-3ipoA:
undetectable		 1mmkA-3ipoA:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MMT_A_H4BA1426_1
(PHENYLALANINE-4-HYDR
OXYLASE)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		5 / 11 LEU A 254
LEU A 145
HIS A 354
TYR A 397
GLU A 393
 None
 0.82A 1mmtA-3ipoA:
undetectable		 1mmtA-3ipoA:
19.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1S14_B_NOVB2300_1
(TOPOISOMERASE IV
SUBUNIT B)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		5 / 12 ASN A  70
SER A 362
ASP A 364
ALA A 100
ILE A  43
 None
 1.41A 1s14B-3ipoA:
undetectable		 1s14B-3ipoA:
18.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1WG8_A_SAMA3142_0
(PREDICTED
S-ADENOSYLMETHIONINE
-DEPENDENT
METHYLTRANSFERASE)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		5 / 12 GLY A 411
GLY A 412
GLY A 386
ASP A 295
ARG A 238
 NA  A 436 ( 3.9A)
None
None
None
NA  A 436 ( 4.0A)
 1.15A 1wg8A-3ipoA:
undetectable		 1wg8A-3ipoA:
20.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VQY_A_PARA1201_2
(AAC(6')-IB)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		3 / 3 TRP A 261
GLN A 259
TRP A  54
 None
 1.27A 2vqyA-3ipoA:
undetectable		 2vqyA-3ipoA:
18.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BJW_C_SVRC507_2
(PHOSPHOLIPASE A2)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		4 / 6 VAL A 311
PHE A 395
ARG A 339
ARG A 300
 None
 1.12A 3bjwF-3ipoA:
undetectable		 3bjwF-3ipoA:
11.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FI0_R_TRPR1001_0
(TRYPTOPHANYL-TRNA
SYNTHETASE)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		5 / 9 GLY A 247
VAL A 284
HIS A 222
ILE A 220
VAL A 251
 None
 1.41A 3fi0R-3ipoA:
undetectable		 3fi0R-3ipoA:
21.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3S3M_A_DLUA398_1
(PFV INTEGRASE)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		4 / 8 ASP A  44
GLY A  53
TYR A 147
PRO A  47
 None
 0.98A 3s3mA-3ipoA:
undetectable		 3s3mA-3ipoA:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEW_C_KANC301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		5 / 12 GLN A  83
ASP A 357
ASN A  70
SER A  74
ARG A  46
 None
 1.34A 4fewC-3ipoA:
0.0
4fewD-3ipoA:
0.0
4fewF-3ipoA:
0.3		 4fewC-3ipoA:
21.43
4fewD-3ipoA:
21.43
4fewF-3ipoA:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LV9_A_20JA601_1
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		4 / 8 SER A 382
ALA A 391
SER A 392
ARG A 238
 None
None
None
NA  A 436 ( 4.0A)
 1.04A 4lv9A-3ipoA:
undetectable
4lv9B-3ipoA:
undetectable		 4lv9A-3ipoA:
22.88
4lv9B-3ipoA:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LV9_B_20JB601_1
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		4 / 7 SER A 382
ALA A 391
SER A 392
ARG A 238
 None
None
None
NA  A 436 ( 4.0A)
 1.06A 4lv9A-3ipoA:
undetectable
4lv9B-3ipoA:
undetectable		 4lv9A-3ipoA:
22.88
4lv9B-3ipoA:
22.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XDR_A_ADNA402_1
(FAD:PROTEIN FMN
TRANSFERASE)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		5 / 12 VAL A 251
GLY A 247
ALA A 246
ILE A 242
VAL A 197
 None
 0.91A 4xdrA-3ipoA:
undetectable		 4xdrA-3ipoA:
24.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4Y0Q_A_PX9A201_1
(BETA-LACTOGLOBULIN)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		3 / 3 LYS A 169
ILE A 171
ILE A 192
 None
 0.61A 4y0qA-3ipoA:
undetectable		 4y0qA-3ipoA:
17.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YVP_B_GBMB402_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C1)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		5 / 12 LEU A 120
VAL A  99
ILE A  43
ASN A  85
LEU A  84
 None
 1.27A 4yvpB-3ipoA:
undetectable		 4yvpB-3ipoA:
21.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IKT_B_TLFB601_0
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		5 / 12 VAL A 197
LEU A 292
GLY A 247
ALA A 246
LEU A 211
 None
 1.27A 5iktB-3ipoA:
undetectable		 5iktB-3ipoA:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MTH_B_ACTB302_0
(ANTIBODY FAB HEAVY
CHAIN
ANTIBODY FAB LIGHT
CHAIN)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		4 / 5 GLU A 318
TYR A 326
TYR A 384
ARG A 390
 None
 1.23A 5mthA-3ipoA:
undetectable
5mthB-3ipoA:
0.0		 5mthA-3ipoA:
21.32
5mthB-3ipoA:
19.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MTH_H_ACTH304_0
(ANTIBODY FAB HEAVY
CHAIN
ANTIBODY FAB LIGHT
CHAIN)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		4 / 5 GLU A 318
TYR A 326
TYR A 384
ARG A 390
 None
 1.20A 5mthH-3ipoA:
undetectable
5mthL-3ipoA:
undetectable		 5mthH-3ipoA:
21.32
5mthL-3ipoA:
19.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MVM_B_PFLB510_1
(PROTON-GATED ION
CHANNEL)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		4 / 6 ILE A 123
ALA A  27
LEU A  26
ILE A 125
 None
 0.80A 5mvmB-3ipoA:
undetectable
5mvmC-3ipoA:
undetectable		 5mvmB-3ipoA:
14.56
5mvmC-3ipoA:
14.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N0T_A_SAMA501_1
(PEPTIDE
N-METHYLTRANSFERASE)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		4 / 5 TYR A 397
SER A 392
ALA A 237
GLN A 144
 None
 1.07A 5n0tA-3ipoA:
undetectable		 5n0tA-3ipoA:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V0V_A_8QPA613_1
(SERUM ALBUMIN)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		4 / 8 ARG A 238
ALA A 391
SER A 347
GLY A 386
 NA  A 436 ( 4.0A)
None
None
None
 1.00A 5v0vA-3ipoA:
undetectable		 5v0vA-3ipoA:
20.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WYQ_A_SAMA401_1
(TRNA
(GUANINE-N(1)-)-METH
YLTRANSFERASE)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		4 / 4 ASP A 364
SER A 362
ASP A 365
HIS A  91
 None
 1.39A 5wyqB-3ipoA:
0.8		 5wyqB-3ipoA:
20.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MKE_D_FK5D201_0
(PEPTIDYLPROLYL
ISOMERASE)		 3ipo PUTATIVE THIOSULFATE
SULFURTRANSFERASE
YNJE
(Escherichia
coli) 		4 / 4 ASP A 109
ILE A 125
PRO A  29
LEU A  26
 None
 1.20A 6mkeA-3ipoA:
undetectable		 6mkeA-3ipoA:
12.71